smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)C(C)(C)C	ZINC000160277615	323064666	/nfs/dbraw/zinc/06/46/66/323064666.db2.gz	CJUULTVRJMINLO-KGLIPLIRSA-N	2	0	240.435	3.275	20	70		BGIDRP
C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)C(C)(C)C	ZINC000160277738	323064658	/nfs/dbraw/zinc/06/46/58/323064658.db2.gz	CJUULTVRJMINLO-KBPBESRZSA-N	2	0	240.435	3.275	20	70		BGIDRP
CC(C)[NH2+]C1CC[NH+](CCC2CCCC2)CC1	ZINC000160497630	167095847	/nfs/dbraw/zinc/09/58/47/167095847.db2.gz	SQSKTDHDKKNBHY-UHFFFAOYSA-N	2	0	238.419	3.029	20	70		BGIDRP
CC(C)[C@@H](C)[NH2+]C[C@@H](C)N(C)Cc1ccccc1	ZINC000160860353	361331347	/nfs/dbraw/zinc/33/13/47/361331347.db2.gz	OWTLGCDBEMSAOF-HUUCEWRRSA-N	2	0	248.414	3.141	20	70		BGIDRP
CC(C)[C@H](C)[NH2+]C[C@@H](C)N(C)Cc1ccccc1	ZINC000160860433	361331609	/nfs/dbraw/zinc/33/16/09/361331609.db2.gz	OWTLGCDBEMSAOF-CABCVRRESA-N	2	0	248.414	3.141	20	70		BGIDRP
CC(C)[C@@H](C)[NH2+]C[C@H](C)N(C)Cc1ccccc1	ZINC000160860552	361331526	/nfs/dbraw/zinc/33/15/26/361331526.db2.gz	OWTLGCDBEMSAOF-LSDHHAIUSA-N	2	0	248.414	3.141	20	70		BGIDRP
CC(C)[C@H](C)[NH2+]C[C@H](C)N(C)Cc1ccccc1	ZINC000160860649	361330956	/nfs/dbraw/zinc/33/09/56/361330956.db2.gz	OWTLGCDBEMSAOF-GJZGRUSLSA-N	2	0	248.414	3.141	20	70		BGIDRP
CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)C1CC1	ZINC000160894302	349335296	/nfs/dbraw/zinc/33/52/96/349335296.db2.gz	BKNJPXVZUXZIOT-INIZCTEOSA-N	2	0	246.398	3.026	20	70		BGIDRP
CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)C1CC1	ZINC000160894456	349335602	/nfs/dbraw/zinc/33/56/02/349335602.db2.gz	BKNJPXVZUXZIOT-MRXNPFEDSA-N	2	0	246.398	3.026	20	70		BGIDRP
C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1	ZINC000161031933	384458562	/nfs/dbraw/zinc/45/85/62/384458562.db2.gz	JLOMSGGBYSSRLP-IMJJTQAJSA-N	2	0	246.398	3.210	20	70		BGIDRP
C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1	ZINC000161032067	384457660	/nfs/dbraw/zinc/45/76/60/384457660.db2.gz	JLOMSGGBYSSRLP-BMFZPTHFSA-N	2	0	246.398	3.210	20	70		BGIDRP
C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1	ZINC000161032181	384456994	/nfs/dbraw/zinc/45/69/94/384456994.db2.gz	JLOMSGGBYSSRLP-BPUTZDHNSA-N	2	0	246.398	3.210	20	70		BGIDRP
C[C@@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccccc1	ZINC000161032314	384458054	/nfs/dbraw/zinc/45/80/54/384458054.db2.gz	JLOMSGGBYSSRLP-KBMXLJTQSA-N	2	0	246.398	3.210	20	70		BGIDRP
C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)C1CCCC1	ZINC000161121019	385742363	/nfs/dbraw/zinc/74/23/63/385742363.db2.gz	RREYDCZZKHKWQB-CFVMTHIKSA-N	2	0	238.419	3.028	20	70		BGIDRP
C[C@@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)C1CCCC1	ZINC000161121144	385742577	/nfs/dbraw/zinc/74/25/77/385742577.db2.gz	RREYDCZZKHKWQB-YUELXQCFSA-N	2	0	238.419	3.028	20	70		BGIDRP
C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)C1CCCC1	ZINC000161121277	385742514	/nfs/dbraw/zinc/74/25/14/385742514.db2.gz	RREYDCZZKHKWQB-QEJZJMRPSA-N	2	0	238.419	3.028	20	70		BGIDRP
C[C@@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)C1CCCC1	ZINC000161121418	385742262	/nfs/dbraw/zinc/74/22/62/385742262.db2.gz	RREYDCZZKHKWQB-SNPRPXQTSA-N	2	0	238.419	3.028	20	70		BGIDRP
CC[N@H+](CCC[NH+]1CCCCC1)C1CCCC1	ZINC000161276771	387175592	/nfs/dbraw/zinc/17/55/92/387175592.db2.gz	ULJWPHHCPXRXEM-UHFFFAOYSA-N	2	0	238.419	3.127	20	70		BGIDRP
C[C@@H](c1ccccc1)[N@H+](C)CCC[NH+]1CCCC1	ZINC000161298245	349418136	/nfs/dbraw/zinc/41/81/36/349418136.db2.gz	QTEXBKSAKHSPDT-HNNXBMFYSA-N	2	0	246.398	3.165	20	70		BGIDRP
C[C@H](c1ccccc1)[N@H+](C)CCC[NH+]1CCCC1	ZINC000161298341	349418040	/nfs/dbraw/zinc/41/80/40/349418040.db2.gz	QTEXBKSAKHSPDT-OAHLLOKOSA-N	2	0	246.398	3.165	20	70		BGIDRP
C[C@@H]1CCC[C@H](C)[N@H+]1CCC[NH+]1CCCCC1	ZINC000161352739	349427511	/nfs/dbraw/zinc/42/75/11/349427511.db2.gz	QQOPJHHOYHFZTK-GASCZTMLSA-N	2	0	238.419	3.125	20	70		BGIDRP